Carbobenzyloxyglycylglycylglycine benzyl ester
TL;DR: Carbobenzyloxyglycylglycylglycine benzyl ester (CAS 102374-02-7) is a chemical compound with molecular formula C21H23N3O6 and molecular weight 413.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 2-[[2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetyl]amino]acetate
Also Known As: CARBOBENZYLOXYGLYCYLGLYCYLGLYCINE BENZYL ESTER, benzyl 2-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)acetamido]acetate, benzyl 2-[[2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetyl]amino]acetate, 667-941-2, RefChem:574247
| Molecular Formula | C21H23N3O6 |
|---|---|
| Molecular Weight | 413.16 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 413.1587 |
| Heavy Atoms | 30 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 102374-02-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)CNC(=O)CNC(=O)CNC(=O)OCC2=CC=CC=C2 |
| InChIKey | ISFYDJTZYYPHLD-UHFFFAOYSA-N |
Product Overview
Carbobenzyloxyglycylglycylglycine benzyl ester (CAS 102374-02-7), with molecular formula C21H23N3O6 and molecular weight 413.16 g/mol. IUPAC: benzyl 2-[[2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetyl]amino]acetate.
Chemical Property Profile of Carbobenzyloxyglycylglycylglycine benzyl ester
Property Insights of Carbobenzyloxyglycylglycylglycine benzyl ester
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbobenzyloxyglycylglycylglycine benzyl ester. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbobenzyloxyglycylglycylglycine benzyl ester. Following Lipinski's Rule of Five, Carbobenzyloxyglycylglycylglycine benzyl ester has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carbobenzyloxyglycylglycylglycine benzyl ester?
The CAS number of Carbobenzyloxyglycylglycylglycine benzyl ester is 102374-02-7.
What is the molecular formula of Carbobenzyloxyglycylglycylglycine benzyl ester?
The molecular formula of Carbobenzyloxyglycylglycylglycine benzyl ester is C21H23N3O6.
What is the molecular weight of Carbobenzyloxyglycylglycylglycine benzyl ester?
The molecular weight of Carbobenzyloxyglycylglycylglycine benzyl ester is 413.16 g/mol.
Where can I buy Carbobenzyloxyglycylglycylglycine benzyl ester?
You can request a quote for Carbobenzyloxyglycylglycylglycine benzyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbobenzyloxyglycylglycylglycine benzyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbobenzyloxyglycylglycylglycine benzyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.